Feedback

ent-cassa-12,15-dien-3beta-ol

MNXM819741 is deprecated and replaced by MNXM511766

Properties

Image

Occurences in reactions

MNX_ID

MNXM511766

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₂₀H₃₂O

charge

mass

288.24532

reference

InChIKey

BHRUCLDHUXEJQR-PHVPSJSMSA-N

InChI

InChI=1S/C20H32O/c1-6-14-7-9-16-15(13(14)2)8-10-17-19(3,4)18(21)11-12-20(16,17)5/h6-7,13,15-18,21H,1,8-12H2,2-5H3/t13-,15-,16-,17-,18-,20+/m1/s1

SMILES

C=CC1=CC[C@@H]2[C@H](CC[C@@H]3C(C)(C)[C@H](O)CC[C@]32C)[C@@H]1C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:72660 chebi:72660	ent-cassa-12,15-dien-3beta-ol (2R,4aS,4bR,8S,8aR,10aS)-1,1,4a,8-tetramethyl-7-vinyl-1,2,3,4,4a,4b,5,8,8a,9,10,10a-dodecahydrophenanthren-2-ol (2R,4aS,4bR,8S,8aR,10aS)-7-ethenyl-1,1,4a,8-tetramethyl-1,2,3,4,4a,4b,5,8,8a,9,10,10a-dodecahydrophenanthren-2-ol 3alpha-hydroxy-ent-cassa-12,15-diene
sabiork.compound:30801 sabiorkM:30801	3alpha-Hydroxy-ent-cassa-12,15-diene 3alpha-Hydroxy-ent-cassadiene ent-cassa-12,15-dien-3alpha-ol