ID: 74530
SMILES:CCCCCc1cc2c(c(O)c1)C1(C=C(C)CO1)OC(C(C)(C)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -9.359
InChIKey:IZRQSCNXLOXDSN-UHFFFAOYSA-N
ID: 74531
SMILES:C1(OC(CCC)=O)C2C(C)(C3C(O)c4c(cc(CCCCC)cc4OC(C)=O)C13)C(=C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -14.821
InChIKey:BUYZEPBWPSSHAG-UHFFFAOYSA-N
ID: 74532
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 74533
SMILES:CC1(C)C2(OC)C(C=C(C)CC2)c2c(cc(O)c(C)c2C(C(C)CC)=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.286
InChIKey:BVYPCIWWMCHWCX-UHFFFAOYSA-N
ID: 74534
SMILES:C(CCCC(=C)CC(=O)O)C(=O)c1c2c(c(O)c(O)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -13.238
InChIKey:VNAUMIQOPYPELX-UHFFFAOYSA-N
ID: 74535
SMILES:C(CC1C(C(=C)C)CCC1C)C(C)=CCc1cc(O)cc(C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.542
InChIKey:SEEXGZLHCPPDQF-UHFFFAOYSA-N
ID: 74536
SMILES:O=C(Cc1c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C(C)(C3C=C1C(C)(C)CCCC1(C)O3)O2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.726
CB1 binding score: -14.757
InChIKey:WDNSEZJQGZLZSP-UHFFFAOYSA-N
ID: 74537
SMILES:C12(C(O)=O)c3c(O)cc(C)cc3OC(C)(C)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 290.359
CB1 binding score: -14.993
InChIKey:VBDSZHBONJKLFR-UHFFFAOYSA-N
ID: 74538
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.732
InChIKey:MQEFSUHHOLLCAA-UHFFFAOYSA-N
ID: 74539
SMILES:O1C(CC=C(C)C)C(C)=CC1C(CC(=CCc1c(O)c(C)cc(OC)c1)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.526
InChIKey:BXQQZJZQDONAMF-UHFFFAOYSA-N
ID: 74540
SMILES:C(=C(C)CCOc1cc(CCCCC)cc(O)c1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.305
InChIKey:WTCSFBLYQWGZFI-UHFFFAOYSA-N
ID: 74541
SMILES:C1=C(C)C2(Cc3c(O)cc(CCCCC)cc3O2)CC(=C(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -17.144
InChIKey:NXVQCKJBPOITGH-UHFFFAOYSA-N
ID: 74542
SMILES:C1(CCC=C(C)C)(C)C=Cc2c(O)c(C(=O)O)cc(CCCCC)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.057
InChIKey:XTECEPJLXBGVGL-UHFFFAOYSA-N
ID: 74543
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC(O)C)c2)C2C1(O)C=CC(OO)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -16.192
InChIKey:SHVDWKBRIZGQJE-UHFFFAOYSA-N
ID: 74544
SMILES:C1(COC(=O)c2c(-c3c(CC=C(C)C)cccc3)cccc2)C(C)=CC(c2c(OC)cc(CCCCC)cc2OC)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 620.874
CB1 binding score: Not available
InChIKey:ONWZGIVLPCOKHV-UHFFFAOYSA-N
ID: 74545
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(COC(=O)C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 74546
SMILES:CC(CC(c1c(O)cc(CCCCC)cc1-c1c(O)c(CC=C(C)CCC=C(C)C)c(O)c(OC)c1O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.725
CB1 binding score: -13.573
InChIKey:NEZIVJWIYFPLEH-UHFFFAOYSA-N
ID: 74547
SMILES:CC1CC2C(C(C)(C)Oc3c(CC=C(CCC=C(C)C)C)ccc(O)c32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.268
InChIKey:CQZJKBYTQMOSES-UHFFFAOYSA-N
ID: 74548
SMILES:C(CCc1cc(O)c(CC(OC(C)CCC2C(C)(C)CC(=O)C=C2C)=O)c(O)c1)(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -15.058
InChIKey:PGFZTZJBCOQTGQ-UHFFFAOYSA-N
ID: 74549
SMILES:c1(O)cc(CCCCC)c(O)c2c1C1C=C(C(=O)O)C3CC(O)(C(O)(C)CCC1C(C)(C)O3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.566
CB1 binding score: -16.319
InChIKey:CQZZLVZTNYOZSD-UHFFFAOYSA-N
ID: 74550
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(COC(C)=O)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N