3-[(4S,6S,10S)-10-[(E,2R)-4-[(2S,2'R,4R,4aS,6R,8aR)-2-(hydroxymethyl)-3-methylidene-4-oxidanyl-spiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]-2'-yl]but-3-en-2-yl]-8-methyl-5,11-dioxaspiro[5.5]undec-7-en-4-yl]-2-methyl-2-oxidanyl-propanoic acid

Systemtic Name: 3-[(4S,6S,10S)-10-[(E,2R)-4-[(2S,2'R,4R,4aS,6R,8aR)-2-(hydroxymethyl)-3-methylidene-4-oxidanyl-spiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]-2'-yl]but-3-en-2-yl]-8-methyl-5,11-dioxaspiro[5.5]undec-7-en-4-yl]-2-methyl-2-oxidanyl-propanoic acid Openeye Name: 3-[(4S,6S,10S)-10-[(E,1R)-3-[(2S,2'R,4R,4aS,6R,8aR)-4-hydroxy-2-(hydroxymethyl)-3-methylene-spiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-tetrahydrofuran]-2'-yl]-1-methyl-allyl]-8-methyl-5,11-dioxaspiro[5.5]undec-7-en-4-yl]-2-hydroxy-2-methyl-propanoic acid CAS Name: 3-[(4S,6S,10S)-10-[(E,2R)-4-[(2S,2'R,4R,4aS,6R,8aR)-4-hydroxy-2-(hydroxymethyl)-3-methylene-2'-spiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]yl]but-3-en-2-yl]-8-methyl-5,11-dioxaspiro[5.5]undec-7-en-4-yl]-2-hydroxy-2-methylpropanoic acid IUPAC Name: 3-[(4S,6S,10S)-10-[(E,2R)-4-[(2S,2'R,4R,4aS,6R,8aR)-4-hydroxy-2-(hydroxymethyl)-3-methylidenespiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]-2'-yl]but-3-en-2-yl]-8-methyl-5,11-dioxaspiro[5.5]undec-7-en-4-yl]-2-hydroxy-2-methylpropanoic acid Traditional Name: 3-[(4S,6S,10S)-10-[(E,1R)-3-[(2S,2'R,4R,4aS,6R,8aR)-4-hydroxy-3-methylene-2-methylol-spiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-tetrahydrofuran]-2'-yl]-1-methyl-allyl]-8-methyl-5,11-dioxaspiro[5.5]undec-7-en-4-yl]-2-hydroxy-2-methyl-propionic acid Formula: C31H46O10 MolecularWeight: 578.69094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2(CCCC(O2)CC(C)(C(=O)O)O)OC(C1)C(C)C=CC3CCC4(O3)CCC5C(O4)C(C(=C)C(O5)CO)O

Isomeric SMILES

CC1=C[C@]2(CCC[C@H](O2)CC(C)(C(=O)O)O)O[C@@H](C1)[C@H](C)/C=C/[C@H]3CC[C@]4(O3)CC[C@@H]5[C@@H](O4)[C@@H](C(=C)[C@H](O5)CO)O

InChI

InChI=1S/C31H46O10/c1-18-14-24(40-31(15-18)11-5-6-22(39-31)16-29(4,36)28(34)35)19(2)7-8-21-9-12-30(38-21)13-10-23-27(41-30)26(33)20(3)25(17-32)37-23/h7-8,15,19,21-27,32-33,36H,3,5-6,9-14,16-17H2,1-2,4H3,(H,34,35)/b8-7+/t19-,21+,22+,23-,24+,25-,26-,27-,29?,30-,31+/m1/s1