Geodiamolide I

AlkaPlorer ID: AK004563

Synonym: None

IUPAC Name: (4R,7R,10S,13S,15E,17R,19R)-7-[(3-bromo-4-hydroxyphenyl)methyl]-4-(4-hydroxyphenyl)-8,10,13,15,17,19-hexamethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetrone

Structure

SMILES: C/C1=C\[C@H](C)C[C@@H](C)OC(=O)C[C@H](C2=CC=C(O)C=C2)N=C(O)[C@@H](CC2=CC=C(O)C(Br)=C2)N(C)C(=O)[C@H](C)N=C(O)[C@@H](C)C1

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InChI: InChI=1S/C34H44BrN3O7/c1-19-13-20(2)15-22(4)45-31(41)18-28(25-8-10-26(39)11-9-25)37-33(43)29(17-24-7-12-30(40)27(35)16-24)38(6)34(44)23(5)36-32(42)21(3)14-19/h7-13,16,20-23,28-29,39-40H,14-15,17-18H2,1-6H3,(H,36,42)(H,37,43)/b19-13+/t20-,21-,22+,23-,28+,29+/m0/s1

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InChIKey: JIHNXPGNCSRXCP-TUDOZXHDSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Geodia corticostylifera Geodia Geodiidae Tetractinellida Demospongiae Porifera Metazoa Eukaryota

Properties Information

Molecule Weight: 686.644

TPSA: 152.24999999999997

MolLogP: 6.606700000000007

Number of H-Donors: 4

Number of H-Acceptors: 7

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information