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(8E)-4-hydroxy-sphing-8-enine-26:0 ceramide

PropertiesImage
MNX_IDMNXM37562 Image of MNXM37562
referencemetacycM:CPD-9805
formulaC44H87NO4
global charge0
mol weight694.183
InChIKeyBNTSRXHBAPIDEL-KMJLKMRPSA-N
InChIInChI=1S/C44H87NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-43(48)45-41(40-46)44(49)42(47)38-36-34-32-30-28-16-14-12-10-8-6-4-2/h30,32,41-42,44,46-47,49H,3-29,31,33-40H2,1-2H3,(H,45,48)/b32-30+/t41-,42+,44-/m0/s1
SMILESCCCCCCCCC/C=C/CCC[C@@H](O)[C@@H](O)[C@H](CO)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C44H87NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-43(48)45-41(40-46)44(49)42(47)38-36-34-32-30-28-16-14-12-10-8-6-4-2/h30,32,41-42,44,46-47,49H,3-29,31,33-40H2,1-2H3,(H,45,48)/b32-30+/t41-,42+,44-/m0/s1 Image of MNXM37562
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][C:43](=[N:45][C@@H:41]([CH2:40][OH:46])[C@@H:44]([C@@H:42]([CH2:38][CH2:36][CH2:34]/[CH:32]=[CH:30]/[CH2:28][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:47])[OH:49])[OH:48]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-9805
metacycM:CPD-9805
BNTSRXHBAPIDEL-KMJLKMRPSA-N 		(8E)-4-hydroxy-sphing-8-enine-26:0 ceramide
(8E)-4-hydroxy-sphing-8-enine-26:0
(8E)-4-hydroxy-sphing-8-enine-ceratinic acid
(8E)-4-hydroxy-sphing-8-enine-ceric acid
(8E)-4-hydroxy-sphing-8-enine-cerinic acid
(8E)-4-hydroxy-sphing-8-enine-cerotic acid
(8E)-4-hydroxy-sphing-8-enine-hexacosanoate
(8E)-4-hydroxy-sphing-8-enine-hexacosanoic acid
hexacosanoyl-4-hydroxy-trans-8-sphingenine

seed.compound:cpd25847
seedM:cpd25847
BNTSRXHBAPIDEL-KMJLKMRPSA-N 		4-hydroxy-8(E)-sphingenine-26:0
(8E)-4-hydroxy-sphing-8-enine-26:0
(8E)-4-hydroxy-sphing-8-enine-26:0 ceramide
(8E)-4-hydroxy-sphing-8-enine-ceratinic acid
(8E)-4-hydroxy-sphing-8-enine-ceric acid
(8E)-4-hydroxy-sphing-8-enine-cerinic acid
(8E)-4-hydroxy-sphing-8-enine-cerotic acid
(8E)-4-hydroxy-sphing-8-enine-hexacosanoate
(8E)-4-hydroxy-sphing-8-enine-hexacosanoic acid
4-hydroxy-trans-8-sphingenine-26:0
4-hydroxy-trans-8-sphingenine-ceratinic acid
4-hydroxy-trans-8-sphingenine-ceric acid
4-hydroxy-trans-8-sphingenine-cerinic acid
4-hydroxy-trans-8-sphingenine-cerotic acid
4-hydroxy-trans-8-sphingenine-hexacosanoate
4-hydroxy-trans-8-sphingenine-hexacosanoic acid
4-hydroxysphing-8(E)-enine-26:0, ceramide
hexacosanoyl-4-hydroxy-trans-8-sphingenine

seedM:M_cpd25847 		secondary/obsolete/fantasy identifier