(Q105343240)

English

(3R,3aR,5aS,5bR,9S,11aS,11bS,13aR,13bR)-3a,5a,8,8,11b,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,9,10,11,11a,12,13,13b-tetradecahydrocyclopenta[a]chrysen-9-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

426.38616622 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,3aR,5aR,5bR,9S,11aS,11bS,13aR,13bR)-3a,5a,8,8,11b,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,9,10,11,11a,12,13,13b-tetradecahydrocyclopenta[a]chrysen-9-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Adian-5-ene-3alpha-ol

1 reference

1 reference

C₃₀H₅₀O

0 references

canonical SMILES

OC1CCC2C(=CCC3C2(C)CCC4(C)C5CCC(C(C)C)C5(C)CCC34C)C1(C)C

0 references

isomeric SMILES

CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@@]1(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@@]3(C)CC[C@]21C

0 references

found in taxon

Rhododendron formosanum

1 reference

stated in

Two isomeric epoxysitosterols from Rhododendron formosanum: 1H and 13C NMR chemical shift assignments

Identifiers

InChI

InChI=1S/C30H50O/c1-19(2)20-9-12-23-27(20,5)15-17-30(8)24-13-10-21-22(11-14-25(31)26(21,3)4)28(24,6)16-18-29(23,30)7/h10,19-20,22-25,31H,9,11-18H2,1-8H3/t20-,22-,23-,24-,25+,27-,28-,29-,30+/m1/s1

0 references

InChIKey

XVXPXUMUGATHPD-AEMPZZHTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XVXPXUMUGATHPD-AEMPZZHTSA-N

(Q105343240)

(3R,3aR,5aS,5bR,9S,11aS,11bS,13aR,13bR)-3a,5a,8,8,11b,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,9,10,11,11a,12,13,13b-tetradecahydrocyclopenta[a]chrysen-9-ol

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