ID: 79969
SMILES:O=Cc1c(O)c2c(cc1CCC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.502
InChIKey:WBPGZWLPQRAYLG-UHFFFAOYSA-N
ID: 79970
SMILES:CC(=C)C1CCC(C)(C(O)=O)C1c1c(O)ccc(CCCCCO)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.772
InChIKey:WCNYIKJTMWWRAC-UHFFFAOYSA-N
ID: 79971
SMILES:c1c(O)c(CC=C(CCC=C(C)C)C)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.441
InChIKey:VPIIPBDTVZXIEC-UHFFFAOYSA-N
ID: 79972
SMILES:C1(=O)C=C(C)C(O)C=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.506
InChIKey:GQDHJMKBDIGUKD-UHFFFAOYSA-N
ID: 79973
SMILES:c1c(CCCCCCCCC)cc(OC)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.57
InChIKey:QMECWUZMDDBTOY-UHFFFAOYSA-N
ID: 79974
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.988
InChIKey:SOJHVNJFTZELFD-UHFFFAOYSA-N
ID: 79975
SMILES:Cc1c(C(CCC(C)C)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.46
InChIKey:ZJIDKBWIJSSFDI-UHFFFAOYSA-N
ID: 79976
SMILES:CC1(C)Oc2c(c3c(c(C)c2)OCO3)CC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.307
InChIKey:VFTMZWZDZPEEHS-UHFFFAOYSA-N
ID: 79977
SMILES:O1c2c(O)cc(CCCCCC)cc2OC(C)(CCC=C(C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.648
InChIKey:HVARNCMPLMYMRR-UHFFFAOYSA-N
ID: 79978
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(O)(C)C3CCC(C)(O)C(=CC12)CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.586
InChIKey:VSBPZPGFYJZOJA-UHFFFAOYSA-N
ID: 79979
SMILES:C1(O)(COC(C)=O)C(=O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -14.788
InChIKey:GTOFLGMNNJSIGR-UHFFFAOYSA-N
ID: 79980
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(=C)C)CCC1(C)C(O)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.367
InChIKey:UCIWCAAISODNCS-UHFFFAOYSA-N
ID: 79981
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -12.085
InChIKey:SRQZLGIQGIWTRM-UHFFFAOYSA-N
ID: 79982
SMILES:OC1(C)C2C(O)CC(C)=CCCC(C(O)=O)=CC2c2c(O)cc(C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -15.284
InChIKey:WQZVCNXHNJWDSY-UHFFFAOYSA-N
ID: 79983
SMILES:Oc1cc(CC=C(CCC=C(C)C)C)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17
InChIKey:CUQLLVPNTXISJP-UHFFFAOYSA-N
ID: 79984
SMILES:C(=CCc1c(O)cc(CCCCC)cc1O)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 79985
SMILES:C1(O)C(C)=CC2C(C(C)(C)Oc3c(C(=O)CC(C)C)c(O)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.609
InChIKey:BOQNKRISRBXHQZ-UHFFFAOYSA-N
ID: 79986
SMILES:C(Oc1cc(CCCCC)ccc1C1C(C(C)C)CCC(C)=C1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.648
CB1 binding score: -14.713
InChIKey:PPCACAJQXDIRIC-UHFFFAOYSA-N
ID: 79987
SMILES:CC12CCC(O)(C(C)(C)O1)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.754
InChIKey:UXDCXZUYZMTQLK-UHFFFAOYSA-N
ID: 79988
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C3OC12C(O)(C)CCC3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -12.865
InChIKey:CTEZHGNGZFPMCO-UHFFFAOYSA-N
ID: 79989
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C=O)=CC21)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.943
InChIKey:CMKPMOWKXOMQAZ-UHFFFAOYSA-N