(Q27254790)

Clethric acid (English)

(1R,2R,4aS,6aR,6aS,6bR,8aR,10R,12aR,14bR)-1,10-dihydroxy-9,9-bis(hydroxymethyl)-1,2,6a,6b,12a-pentamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

14 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,2R,4aR,6aR,6aS,6bR,8aR,10R,12aR,14bS)-1,10-dihydroxy-9,9-bis(hydroxymethyl)-1,2,6a,6b,12a-pentamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₈O₆

1 reference

Clethric acid (English)

14 October 2016

canonical SMILES

CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(CO)CO)O)C)C)C2C1(C)O)C)C(=O)O

1 reference

Clethric acid (English)

14 October 2016

isomeric SMILES

C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@H](C5(CO)CO)O)C)C)[C@@H]2[C@]1(C)O)C)C(=O)O

1 reference

An oleanane acid from Alibertia edulis

Clethric acid (English)

14 October 2016

1 reference

Psychotria correae

1 reference

Alkaloids and other compounds from Psychotria correae

Clethra barbinervis

1 reference

Studies on the constituents of the medicinal plants. XXI. Constituents of the leaves of Clethra barbinervis Sieb. et Zucc. (2) and the 13C-nuclear magnetic resonance spectra of 19.ALPHA.-hydroxyurs-12-en-28-oic acid type of triterpenoids.

Mussaenda pubescens

2 references

Triterpenes and triterpenoid saponins from Mussaenda pubescens

Triterpenes and triterpenoid saponins from Mussaenda pubescens

Neolamarckia cadamba

2 references

Two new triterpenoid glycosides from the leaves of Anthocephalus chinensis

Two new steroidal saponins from Neolamarckia cadamba

Neonauclea purpurea

2 references

Two new triterpenoid glycosides from the leaves of Anthocephalus chinensis

Two new steroidal saponins from Neolamarckia cadamba

Morinda citrifolia

1 reference

New constituents from the leaves of Morinda citrifolia.

Identifiers

InChI

InChI=1S/C30H48O6/c1-18-8-13-29(24(34)35)15-14-26(3)19(23(29)28(18,5)36)6-7-20-25(2)11-10-22(33)30(16-31,17-32)21(25)9-12-27(20,26)4/h6,18,20-23,31-33,36H,7-17H2,1-5H3,(H,34,35)/t18-,20-,21-,22-,23-,25-,26-,27-,28-,29+/m1/s1

1 reference

Clethric acid (English)

MDDPTIWFHAUVPJ-YIHHDBOSSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

Clethric acid (English)

14 October 2016

1 reference

UNII

2IL807ME4O

clethric acid (English)

14 October 2016

1 reference

Clethric acid (English)

14 October 2016

2 references

Clethric acid (English)

matched by identifier from

14 October 2016

InChIKey

MDDPTIWFHAUVPJ-YIHHDBOSSA-N

1 reference

2 references

Global Substance Registration System

UNII

2IL807ME4O

clethric acid (English)