Technical Information

Formal Name

2,3,3a,4,5,6,6a,9,10,11,12,15-dodecahydro-6,12,15-trihydroxy-4,10,12-trimethyl-5-methylene-3-(phenylmethyl)-1H-cycloundec[d]isoindol-1-one

CAS Number

53760-20-6

Molecular Formula

C28H37NO4

Formula Weight

451.6

Purity

≥95%

Formulation(Request formulation change)

A lyophilisate

Solubility(Learn about Variance in Solubility)

• DMF: Soluble

• DMSO: Soluble

• Ethanol: Soluble

• Methanol: Soluble

SMILES

O=C1N[C@@H](CC2=CC=CC=C2)[C@]([C@]31[C@H](O)/C=C/[C@](C)(O)C[C@@H](C)C/C=C/[C@@]3([H])[C@@H]4O)([H])[C@H](C)C4=C

InChi Code

InChI=1S/C28H37NO4/c1-17-9-8-12-21-25(31)19(3)18(2)24-22(15-20-10-6-5-7-11-20)29-26(32)28(21,24)23(30)13-14-27(4,33)16-17/h5-8,10-14,17-18,21-25,30-31,33H,3,9,15-16H2,1-2,4H3,(H,29,32)/b12-8+,14-13+/t17-,18+,21-,22-,23+,24-,25+,27-,28+/m0/s1

InChi Key

UKQNIEMKORIOQM-RPSWBRMKSA-N

Origin

Fungi/Phomopsis sp.