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streptolydigin

MNXM161294 is deprecated and here replaced by MNXM1368494
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368494 Image of MNXM1368494
referencechebi:45773
formulaC32H44N2O9
global charge0
mol weight600.709
InChIKeyKVTPRMVXYZKLIG-NCAOFHFGSA-N
InChIInChI=1S/C32H44N2O9/c1-16(14-17(2)28-18(3)23-12-13-32(15-40-32)31(6,42-23)43-28)8-9-22(36)25-27(37)26(19(4)29(38)33-7)34(30(25)39)24-11-10-21(35)20(5)41-24/h8-9,12-14,17-21,23-24,26,28,35-36H,10-11,15H2,1-7H3,(H,33,38)/b9-8+,16-14+,25-22+/t17-,18+,19+,20+,21+,23-,24+,26+,28-,31-,32-/m1/s1
SMILESCNC(=O)[C@@H](C)[C@H]1C(=O)/C(=C(O)/C=C/C(C)=C/[C@@H](C)[C@H]2O[C@@]3(C)O[C@H](C=C[C@@]34CO4)[C@@H]2C)C(=O)N1[C@@H]1CC[C@H](O)[C@H](C)O1
MNX internals
InChI (mnx)InChI=1/C32H44N2O9/c1-16(14-17(2)28-18(3)23-12-13-32(15-40-32)31(6,42-23)43-28)8-9-22(36)25-27(37)26(19(4)29(38)33-7)34(30(25)39)24-11-10-21(35)20(5)41-24/h8-9,12-14,17-21,23-24,26,28,35-36H,10-11,15H2,1-7H3,(H,33,38)/b9-8+,16-14+,25-22+/t17-,18+,19+,20+,21+,23-,24+,26+,28-,31-,32-/m1/s1 Image of MNXM1368494
SMILES (mnx)[CH3:1][C:16](/[CH:8]=[CH:9]/[C:22](=[C:25]1/[C:27](=[O:37])[C@H:26]([C@H:19]([CH3:4])[C:29](=[N:33][CH3:7])[OH:38])[N:34]([C@@H:24]2[CH2:11][CH2:10][C@H:21]([OH:35])[C@H:20]([CH3:5])[O:41]2)[C:30]1=[O:39])[OH:36])=[CH:14]\[C@@H:17]([CH3:2])[C@@H:28]1[C@@H:18]([CH3:3])[C@H:23]2[CH:12]=[CH:13][C@@:32]3([CH2:15][O:40]3)[C@:31]([CH3:6])([O:42]2)[O:43]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:45773
chebi:45773
KVTPRMVXYZKLIG-NCAOFHFGSA-N 		streptolydigin
(2S)-2-{(2S,4E)-4-{(2E,4E,6R)-6-[(1R,2R,5R,6S,7R)-1,6-dimethylspiro[8,9-dioxabicyclo[3.3.1]non-3-ene-2,2'-oxiran]-7-yl]-1-hydroxy-4-methylhepta-2,4-dien-1-ylidene}-1-[(2S,5S,6S)-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]-3,5-dioxopyrrolidin-2-yl}-N-methylpropanamide
Antibiotic D-45
NSC 3360

metacyc.compound:CPD-18222
metacycM:CPD-18222
KVTPRMVXYZKLIG-JRVYQZSFSA-N 		streptolidigin