ID: 100864
SMILES:CSc1c(O)c2c(c(OC)c1)C1C(CC=C(CCC=C(C)C)C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.573
CB1 binding score: -15.721
InChIKey:KPTXIBFTOOPWOF-UHFFFAOYSA-N
ID: 100865
SMILES:C1CCC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.844
InChIKey:PWPQLXXOFXROSJ-UHFFFAOYSA-N
ID: 100866
SMILES:CC(=CCCC(C1C2C(C=O)C(C1O)c1c(O)c(C(OC)=O)c(CCC)cc1OC2(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -15.199
InChIKey:UPOLLFRJQVVGGO-UHFFFAOYSA-N
ID: 100867
SMILES:c1(O)c(C(=O)C(C)C)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.7
InChIKey:SXIUURVTHQHIHP-UHFFFAOYSA-N
ID: 100868
SMILES:CC1=CC(c2c(C)cc(C)cc2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -18.317
InChIKey:BLBMZPIDLRMSIY-UHFFFAOYSA-N
ID: 100869
SMILES:CC(C)C1CCC(C)=CC1c1cc(CCCCCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.567
CB1 binding score: -13.968
InChIKey:YGWHOKTWQJXHAX-UHFFFAOYSA-N
ID: 100870
SMILES:C1C(C(C)(O)C)CC2C(C)(Oc3cc(CCCCC)cc(O)c3C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.591
InChIKey:YISXQRBYNWXKFN-UHFFFAOYSA-N
ID: 100871
SMILES:CC(=O)C=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.52
InChIKey:JGNARUBYBBOFIW-UHFFFAOYSA-N
ID: 100872
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C(O)CCC(C)(C=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.257
InChIKey:KLILNPFKOOVKDW-UHFFFAOYSA-N
ID: 100873
SMILES:c1(O)cc(C2C(C(=C)C)CCC(C)=C2)c(O)c2c1cccc2CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.502
CB1 binding score: -14.135
InChIKey:LOQONRXWFCSHCI-UHFFFAOYSA-N
ID: 100874
SMILES:C1C2(CC(Br)=C(C)C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.365
CB1 binding score: -13.327
InChIKey:UDEYYPXJLFLBDB-UHFFFAOYSA-N
ID: 100875
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 100876
SMILES:C12C(CCC(C)=C1)C(C)(C)Oc1c2ccc(C(O)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.929
InChIKey:JHTLXLYXVMDBFT-UHFFFAOYSA-N
ID: 100877
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 100878
SMILES:C1(C)(C)CCCC(C)=CC(=O)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.254
InChIKey:UPBWKDFYCODZGV-UHFFFAOYSA-N
ID: 100879
SMILES:CC(=CCc1c(O)cc(CCCCC)c(C(=O)OC(C(CC(C)C)C(O)=O)=O)c1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.529
CB1 binding score: -15.929
InChIKey:DRIZFVFHYYIHJX-UHFFFAOYSA-N
ID: 100880
SMILES:C12CC3C(C)(CC3C1C(C)C)Oc1c2c(O)cc(CCCCC)c1Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -14.098
InChIKey:KWVDQRCJTGOAMW-UHFFFAOYSA-N
ID: 100881
SMILES:O(C(c1cc2c(cc1C)OC(C)(C)C1C2C=C(C)CC1)CC)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.477
InChIKey:PVWGLYZRKYEIAT-UHFFFAOYSA-N
ID: 100882
SMILES:CC1=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: 100883
SMILES:C(=O)c1c(C(C)C=C)c2c(c(O)c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.579
InChIKey:JHTHWDISEPGHMI-UHFFFAOYSA-N
ID: 100884
SMILES:C12CCC(C)=C(CCC(O)(C)C1Oc1c(c(O)cc(CCCCC)c1)OC)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -15.929
InChIKey:LLWKUAZMRCSDRZ-UHFFFAOYSA-N