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(S)-Nerolidol 3-O-[a-L-rhamnopyranosyl-(1->2)-b-D-glucopyranoside]

PropertiesImage
MNX_IDMNXM115469 Image of MNXM115469
referencechebi:173300
formulaC27H46O10
global charge0
mol weight530.655
InChIKeyATWXTQLIHDYQCP-FOWTUZBSSA-N
InChIInChI=1S/C27H46O10/c1-7-27(6,13-9-12-16(4)11-8-10-15(2)3)37-26-24(22(32)20(30)18(14-28)35-26)36-25-23(33)21(31)19(29)17(5)34-25/h7,10,12,17-26,28-33H,1,8-9,11,13-14H2,2-6H3/b16-12+
SMILESC=CC(C)(CC/C=C(\C)CCC=C(C)C)OC1OC(CO)C(O)C(O)C1OC1OC(C)C(O)C(O)C1O
MNX internals
InChI (mnx)InChI=1/C27H46O10/c1-7-27(6,13-9-12-16(4)11-8-10-15(2)3)37-26-24(22(32)20(30)18(14-28)35-26)36-25-23(33)21(31)19(29)17(5)34-25/h7,10,12,17-26,28-33H,1,8-9,11,13-14H2,2-6H3/b16-12+/t17?,18?,19?,20?,21?,22?,23?,24?,25?,26?,27? Image of MNXM115469
SMILES (mnx)[CH2:1]=[CH:7][C:27]([CH3:6])([CH2:13][CH2:9]/[CH:12]=[C:16](\[CH3:4])[CH2:11][CH2:8][CH:10]=[C:15]([CH3:2])[CH3:3])[O:37][CH:26]1[CH:24]([O:36][CH:25]2[CH:23]([OH:33])[CH:21]([OH:31])[CH:19]([OH:29])[CH:17]([CH3:5])[O:34]2)[CH:22]([OH:32])[CH:20]([OH:30])[CH:18]([CH2:14][OH:28])[O:35]1
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

CHEBI:173300
chebi:173300
ATWXTQLIHDYQCP-FOWTUZBSSA-N
(S)-Nerolidol 3-O-[a-L-rhamnopyranosyl-(1->2)-b-D-glucopyranoside]
2-[4,5-dihydroxy-6-(hydroxymethyl)-2-[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
hmdb:HMDB0040844
ATWXTQLIHDYQCP-FOWTUZBSSA-N
(S)-Nerolidol 3-O-[a-L-rhamnopyranosyl-(1->2)-b-D-glucopyranoside]
2-{[4,5-dihydroxy-6-(hydroxymethyl)-2-{[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]oxy}oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

hmdb:HMDB40844
secondary/obsolete/fantasy identifier