Kahalalide Z1 

AlkaPlorer ID: AK303436

Synonym: None

IUPAC Name: None

Structure

SMILES: C/C=C1\NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C(C)CC)NC(=O)C(C(C)CC)NC(=O)C(NC(=O)C(CC(C)C)NC(=O)C(CCCN)NC(=O)C2CCCN2C(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CCC)C(C)C)C(C)O)C(C)C)C(C)C)C(C)OC(=O)C(C(C)C)NC1=O

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InChI: InChI=1S/C73H120N14O16/c1-19-28-52(89)79-53(38(7)8)66(95)85-59(44(17)88)70(99)80-54(39(9)10)67(96)81-55(40(11)12)72(101)87-34-27-32-51(87)65(94)76-48(31-26-33-74)62(91)77-49(35-37(5)6)64(93)86-60-45(18)103-73(102)56(41(13)14)82-61(90)47(22-4)75-63(92)50(36-46-29-24-23-25-30-46)78-68(97)57(42(15)20-2)83-69(98)58(43(16)21-3)84-71(60)100/h22-25,29-30,37-45,48-51,53-60,88H,19-21,26-28,31-36,74H2,1-18H3,(H,75,92)(H,76,94)(H,77,91)(H,78,97)(H,79,89)(H,80,99)(H,81,96)(H,82,90)(H,83,98)(H,84,100)(H,85,95)(H,86,93)/b47-22-

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InChIKey: SCQHXOHWDJKUSG-IHMICIGVSA-N

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Reference

CAS: 1865764-26-6

Source

Species Genus Family Order Class Phylum Kingdom Domain
Elysia ornata Elysia Plakobranchidae None Gastropoda Mollusca Metazoa Eukaryota

Properties Information

Molecule Weight: 1449.8449999999982

TPSA: 442.0599999999999

MolLogP: 1.2002999999999815

Number of H-Donors: 14

Number of H-Acceptors: 17

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information