ID: 99352
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 99353
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C3C1OC(C(O)(C)C)CCC3(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.474
InChIKey:ZXSJCWBXWDLTAY-UHFFFAOYSA-N
ID: 99354
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C=C(CCC=C(C)C)C)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.073
InChIKey:IUUZOFGOIPRILU-UHFFFAOYSA-N
ID: 99355
SMILES:C1C(C(C)C)C(c2c(O)cc(CC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.748
InChIKey:LLAAZDYTZYGRPH-UHFFFAOYSA-N
ID: 99356
SMILES:O(c1c2c(c(C(C(C)O)CC)cc1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.395
InChIKey:KFVUMHMBBPLWNM-UHFFFAOYSA-N
ID: 99357
SMILES:C1CCC23c4c(cc(CCCCC)cc4OC)CC(C)(C2C1OC)OC3(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -17.702
InChIKey:JXFALCXOVGZWLT-UHFFFAOYSA-N
ID: 99358
SMILES:C1(=O)C2(C)COC(=O)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -15.577
InChIKey:RWRFUDFGFRQFEJ-UHFFFAOYSA-N
ID: 99359
SMILES:C1(C)(O)C2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 99360
SMILES:O1C(CO)C(O)C(O)C(O)C1Oc1c(O)c2c(cc1C(CCC(C)C)=O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.619
CB1 binding score: -15.288
InChIKey:IZDFPAFKSMRTCF-UHFFFAOYSA-N
ID: 99361
SMILES:C1(C(=O)O)=CC2C(CC1)C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.195
InChIKey:VPBHUGWJPCPNEC-UHFFFAOYSA-N
ID: 99362
SMILES:C1(C)CC(C=C(C)C)(O)Oc2c(ccc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.015
InChIKey:YEHLSWGPSAZCOS-UHFFFAOYSA-N
ID: 99363
SMILES:C(C)C(C(=O)C(c1c2c(ccc1O)OC(C)(C)C1C2CC(C)=CC1)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -13.749
InChIKey:PLCAIGXECFKPRZ-UHFFFAOYSA-N
ID: 99364
SMILES:C(C)CCC(=O)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.88
InChIKey:GNDLPZNASUORKF-UHFFFAOYSA-N
ID: 99365
SMILES:CCCCCc1cc(O)c2c(c1)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: 99366
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -16.124
InChIKey:LRIDODXBBYTTIP-UHFFFAOYSA-N
ID: 99367
SMILES:O=Cc1c(OC)c2c(c(C(C)c3ccccc3)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -14.625
InChIKey:NKOAZMLVQGUAHZ-UHFFFAOYSA-N
ID: 99368
SMILES:Oc1c(CCCCC)cc(O)c2c1OC(C)(C)C1=C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.936
InChIKey:UMFVCIKBWJVQBO-UHFFFAOYSA-N
ID: 99369
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1=O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 99370
SMILES:c1(=O)c2c(O)c(C3C(C(C)=C)CCC(C)=C3)c(O)cc(C)c2ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.43
CB1 binding score: -14.55
InChIKey:AWCXNGCEFFPGTD-UHFFFAOYSA-N
ID: 99371
SMILES:c1(O)cc(CCCCC)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N
ID: 99372
SMILES:Oc1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N