ID: 104560
SMILES:C1C(C)C2(Oc3cc(-c4c(O)cc(CCCCC)cc4OC)cc(CCCC(C)=C)c3C2)C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.755
CB1 binding score: -14.605
InChIKey:PWWJLSMLDLNOKG-UHFFFAOYSA-N
ID: 104561
SMILES:O=C(O)C1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 104562
SMILES:CC(C)=CCC1(O)c2c(ccc(CCCCC)c2)OC(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.813
InChIKey:ZUOFQNVUFOXOCS-UHFFFAOYSA-N
ID: 104563
SMILES:COc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 104564
SMILES:O(c1cc(CC)cc2c1C1=CC(C)(O)CCC1C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -13.842
InChIKey:VPHDLOUNVQDUOQ-UHFFFAOYSA-N
ID: 104565
SMILES:c1c2c(ccc1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 104566
SMILES:C12(O)CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.56
InChIKey:VBPOXSBFZQHISD-UHFFFAOYSA-N
ID: 104567
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: 104568
SMILES:C(c1cc(O)cc(C2C=C(C)CCC2C(=C)C)c1)CC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.897
InChIKey:BTCGUOKZZFQKQS-UHFFFAOYSA-N
ID: 104569
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2C2C=C(CO)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.153
InChIKey:FHFWMWLGGRCLAF-UHFFFAOYSA-N
ID: 104570
SMILES:OC1CC(C(O)(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.88
InChIKey:WLCIBYYEYMEEIL-UHFFFAOYSA-N
ID: 104571
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCC)cc2C)CC(C)(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.863
InChIKey:FZXACQSSGJALOZ-UHFFFAOYSA-N
ID: 104572
SMILES:C1(C)=CCC(c2c(O)cc(CCCCC)cc2OC)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.151
InChIKey:DDXWDQWPWVGXTI-UHFFFAOYSA-N
ID: 104573
SMILES:CC(C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 104574
SMILES:C1(C)(O)C(O)CC(C(C=O)=C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.248
InChIKey:NITQLFXCYMXTTC-UHFFFAOYSA-N
ID: 104575
SMILES:C(CCCCc1cc2c(c(O)c1)C1=C(CC2C)C(C)(C)Oc3c(CC=C(C)C)cc(cc3)CC(=O)C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.723
CB1 binding score: -15.12
InChIKey:AACFDILXSICKDD-UHFFFAOYSA-N
ID: 104576
SMILES:C1CC(C(CO)C)=C2Cc3c(cc(CCCCC)cc3O)OC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.185
InChIKey:VMRIRJOCAXBSNC-UHFFFAOYSA-N
ID: 104577
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C12CO2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.274
InChIKey:FLPIOMVAPFHJMX-UHFFFAOYSA-N
ID: 104578
SMILES:O=C(CCC(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC)OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.905
InChIKey:YABNIUSQFNYTNU-UHFFFAOYSA-N
ID: 104579
SMILES:CC1=CC2C(CC1=O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.55
InChIKey:IPEPGLGXKFDNSV-UHFFFAOYSA-N
ID: 104580
SMILES:c1(CCCCC)cc2c(c(O)c1)C1(C(C(C)CCC=C(C)C)C=C(CO)C(=O)C1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -12.001
InChIKey:WEQOYAUFGNIJQB-UHFFFAOYSA-N