ID: 96475
SMILES:Oc1cc(CCCC)ccc1C=C(CCC=C(C)CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -13.262
InChIKey:ADXDDSOTVPJWKI-UHFFFAOYSA-N
ID: 96476
SMILES:c1(C)cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.913
InChIKey:USHZBDBBZHEKPJ-UHFFFAOYSA-N
ID: 96477
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 96478
SMILES:c1(OC)c2c(c(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.83
InChIKey:JBVCMSKBEYIRGL-UHFFFAOYSA-N
ID: 96479
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 96480
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 96481
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.813
InChIKey:CFDJNJRNPRDHMH-UHFFFAOYSA-N
ID: 96482
SMILES:CC(C)C1c2c(ccc(C)c2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -17.111
InChIKey:AGVGYSMDQFJPRR-UHFFFAOYSA-N
ID: 96483
SMILES:CC1(C)C2C(c3c(O)cc(CC)cc3O1)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 96484
SMILES:C1(O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.262
InChIKey:SMFSFWIGRWXZQH-UHFFFAOYSA-N
ID: 96485
SMILES:C12C(C)(Oc3c(c(O)cc(CCCCC)c3)C1O)CCC(C(=C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.334
InChIKey:QQKASCCKTAITEH-UHFFFAOYSA-N
ID: 96486
SMILES:c12cc3c(cc1C)OC(C)(C)C1CCC(C)=CC1(C2=O)OC(C)(C)C=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -16.965
InChIKey:ZKVVLLHFRWXTTC-UHFFFAOYSA-N
ID: 96487
SMILES:Oc1c(CC2(C)C3=C(C(C(OC4C(C)(C)Oc5cc(CCCCC)cc(O)c54)=O)C3O)CC=C(C)C2=O)cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.713
CB1 binding score: -14.722
InChIKey:PHXCQNCXBVKFGU-UHFFFAOYSA-N
ID: 96488
SMILES:CCCCCCc1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -18.696
InChIKey:WUEBHOMMWUKSEU-UHFFFAOYSA-N
ID: 96489
SMILES:C12C=C(C)C(=O)CC1C(C)(C)Oc1c(ccc(CCCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.302
InChIKey:YBHZJAQRCIRSQA-UHFFFAOYSA-N
ID: 96490
SMILES:O=C(Oc1cc2c(cc1CCCCC)OC(C)(C)C1CC=C(C)C(CC(O)=O)C21OC(C)=O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.632
CB1 binding score: -14.652
InChIKey:CKYREZPNGUOHOR-UHFFFAOYSA-N
ID: 96491
SMILES:CC12c3ccc(C)c(CCCCC)c3OC3OC(C)(C)C(C1)CC23
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.876
InChIKey:ALQAVBNHDDQOSW-UHFFFAOYSA-N
ID: 96492
SMILES:CCCCCc1cc2c(c(O)c1)OC(C)(C)C1C2C(O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.257
InChIKey:DTBPWQZDBCHHNT-UHFFFAOYSA-N
ID: 96493
SMILES:C1(C)=CCC2C1c1c(cc(C)c(C(=O)CCCOC)c1)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.37
InChIKey:BORPSRULDADLMU-UHFFFAOYSA-N
ID: 96494
SMILES:C1C(C(C)C)c2c(c(O)cc(C)c2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.354
InChIKey:YTSRAABEMQXNBR-UHFFFAOYSA-N
ID: 96495
SMILES:CC1=CC2c3c(c4c(c(O)c3C)CC(C)C4=O)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.32
InChIKey:LEDWUXHHVKKHEM-UHFFFAOYSA-N