ID: 63442
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 63443
SMILES:C(C(=Cc1c(OC)cc(CCCCC)cc1O)C)CC(=C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.603
InChIKey:BUFMASCGEMFXGQ-UHFFFAOYSA-N
ID: 63444
SMILES:C(C(=O)O)C(CC(O)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -16.015
InChIKey:FEWGQUDXIOFXII-UHFFFAOYSA-N
ID: 63445
SMILES:C(Cc1c(CCCC)cc2c3c1C1C(C(C)(C)O2)CCC(C)(O1)C3)(CC(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.502
InChIKey:HTZRIYRMLABGPG-UHFFFAOYSA-N
ID: 63446
SMILES:CC1(CO)Oc2c(C(O)=O)c(CCCCC)cc(O)c2C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.346
CB1 binding score: -15.753
InChIKey:MMAGGUIEJGEGGL-UHFFFAOYSA-N
ID: 63447
SMILES:c1(CCC)c(C)cc2c(c1)C1C3C(C)(CCC3C(C)(C)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.683
InChIKey:KORNGNWOKWITOS-UHFFFAOYSA-N
ID: 63448
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 63449
SMILES:CC1CCC(C(CO)C)C(c2c(O)cc(CCCCC)cc2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -18.63
InChIKey:SJTJMBPXHPGNHU-UHFFFAOYSA-N
ID: 63450
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCc4ccc(OC(=O)C)cc4)c(O)c(C(C(C)CC)=O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -16.502
InChIKey:BTLVBMKDRFUFKU-UHFFFAOYSA-N
ID: 63451
SMILES:C1=C(C)C(=O)C(O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.82
InChIKey:RWWUDFZTNYXBAP-UHFFFAOYSA-N
ID: 63452
SMILES:CC(C1CCC2(C)Oc3c(c(O)cc(C)c3)C2C1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 328.496
CB1 binding score: -17.029
InChIKey:UJRXSOVZCSUTQZ-UHFFFAOYSA-N
ID: 63453
SMILES:C1(C)=CC(c2c(O)cc(C)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 63454
SMILES:C1(CO)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 63455
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 63456
SMILES:c1cc(OC)cc(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.07
InChIKey:GOPCVFILFYCAHC-UHFFFAOYSA-N
ID: 63457
SMILES:C1(O)CC(c2c(O)cc(CCCCC)cc2O)CC(C)(O)C1Br
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.314
CB1 binding score: -15.916
InChIKey:WTUSTJGUFXVCEK-UHFFFAOYSA-N
ID: 63458
SMILES:C1(=C)CCCC2(C)C1C(OC(=O)C)c1c(O)c(-c3c(OC)c(O)c(CCCCC)cc3O)c(O)c(CC=C(C)C)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 580.718
CB1 binding score: -14.605
InChIKey:SVJNBKZMDRRBDW-UHFFFAOYSA-N
ID: 63459
SMILES:C(CCCC)CCCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -18.334
InChIKey:HXPWAXPFMKPESR-UHFFFAOYSA-N
ID: 63460
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(=CC1=O)C1(C)C(C(C)(C)C(O)CC1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.12
InChIKey:FAUDSWJQXMETED-UHFFFAOYSA-N
ID: 63461
SMILES:c1(C(C)C)c(-c2c(CCC)c3ccccc3[nH]2)cc2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 427.632
CB1 binding score: -14.665
InChIKey:GIGFTSIDHLHMSJ-UHFFFAOYSA-N
ID: 63462
SMILES:CC1(C)CC(=O)CC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.218
InChIKey:NZJAZEIURWPQHP-UHFFFAOYSA-N