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(+)-(5S,6S,7S,8R,10R)-6-hydroxy-7,8-epoxy-12-oxo-abieta-9(11),13-dien-20-oic acid 6,20-lactone

PropertiesImage
MNX_IDMNXM100726 Image of MNXM100726
referencechebi:70554
formulaC20H24O4
global charge0
mol weight328.408
InChIKeyCMURQFGSNXTIKZ-IEYYFSCXSA-N
InChIInChI=1S/C20H24O4/c1-10(2)11-9-20-13(8-12(11)21)19-7-5-6-18(3,4)15(19)14(16(20)24-20)23-17(19)22/h8-10,14-16H,5-7H2,1-4H3/t14-,15-,16-,19-,20+/m0/s1
SMILESCC(C)C1=C[C@]23O[C@H]2[C@H]2OC(=O)[C@@]4(CCCC(C)(C)[C@H]24)C3=CC1=O
MNX internals
InChI (mnx)InChI=1/C20H24O4/c1-10(2)11-9-20-13(8-12(11)21)19-7-5-6-18(3,4)15(19)14(16(20)24-20)23-17(19)22/h8-10,14-16H,5-7H2,1-4H3/t14-,15-,16-,19-,20+/m0/s1 Image of MNXM100726
SMILES (mnx)[CH3:1][CH:10]([CH3:2])[C:11]1=[CH:9][C@@:20]23[C:13](=[CH:8][C:12]1=[O:21])[C@@:19]14[CH2:7][CH2:5][CH2:6][C:18]([CH3:3])([CH3:4])[C@@H:15]1[C@@H:14]([C@@H:16]2[O:24]3)[O:23][C:17]4=[O:22]
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:70554
chebi:70554
CMURQFGSNXTIKZ-IEYYFSCXSA-N
(+)-(5S,6S,7S,8R,10R)-6-hydroxy-7,8-epoxy-12-oxo-abieta-9(11),13-dien-20-oic acid 6,20-lactone
(4aR,5aS,6S,6aS,10aR)-7,7-dimethyl-3-(propan-2-yl)-6,6a,7,8,9,10-hexahydro-2H,5aH-6,10a-(epoxymethano)phenanthro[8a,9-b]oxirene-2,11-dione