ID: 114010
SMILES:c1(O)c2oc(CO)cc2c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -13.076
InChIKey:PCAHAZVBBSYKGA-UHFFFAOYSA-N
ID: 114011
SMILES:C1C(C(O)=O)CC(OC(=O)C)C(C(C)(C)O)C1c1c(O)cc(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.518
CB1 binding score: -15.379
InChIKey:DXRPMNOENFGMMS-UHFFFAOYSA-N
ID: 114012
SMILES:c12c3c(cc(CCCCC)c1)OC(C)(C)C2CCC3C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -15.192
InChIKey:RYIBUUSJXMHAKT-UHFFFAOYSA-N
ID: 114013
SMILES:C(C(=O)C(C)(C)Oc1cc(CCCCC)cc2c1-c1cc(C)ccc1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.028
InChIKey:TWELRQJQMCETTB-UHFFFAOYSA-N
ID: 114014
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(=O)C(C)=CC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.247
InChIKey:XKAQBMQVLKIWIC-UHFFFAOYSA-N
ID: 114015
SMILES:Oc1c(CCCCC)cc2c(c1O)C1CC(C(=C)C)CCC(C)(O2)CCC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.496
InChIKey:NYRBPERTQOEUTF-UHFFFAOYSA-N
ID: 114016
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(COC)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.881
InChIKey:PQZMQHVIZFPKQU-UHFFFAOYSA-N
ID: 114017
SMILES:C1=C(CO)C(O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 114018
SMILES:c12cc(C)c(CCNC(=O)c3ccccc3)cc1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 389.539
CB1 binding score: -12.691
InChIKey:VQJTVYNDYSXURU-UHFFFAOYSA-N
ID: 114019
SMILES:c1(C)c(O)c(C2C(C(C)C)CCC(C)=C2)c(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.535
InChIKey:SLRBFKHLEHDORL-UHFFFAOYSA-N
ID: 114020
SMILES:C1CC(C(C)C)=C2C(O)CC(O)(C)C(Oc3cc(CCCCC)cc(O)c3C12)C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.435
InChIKey:NVISWTHYXQIDOB-UHFFFAOYSA-N
ID: 114021
SMILES:C(C(=O)Oc1cc(C)c(O)c2c1C1C=C(C)C(=O)CC1C(C)(C)O2)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.253
InChIKey:ZPDFPCWOAKQTSF-UHFFFAOYSA-N
ID: 114022
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2CC1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 114023
SMILES:CC(=C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -20.344
InChIKey:ZELUXPWDPVXUEI-UHFFFAOYSA-N
ID: 114024
SMILES:C1(O)C=C(C)CC(c2c(O)cc(CCCCC)cc2O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.701
InChIKey:YUNYJIIFBXHQAK-UHFFFAOYSA-N
ID: 114025
SMILES:C1(=O)C(C)=C(O)CC(C(C)=C)c2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.739
InChIKey:GLAIXNHSCDLGFH-UHFFFAOYSA-N
ID: 114026
SMILES:C1C(CC)=C(C)C(C2Cc3c(cc(O)cc3C)OC2(C)C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.302
InChIKey:PUHLTVAHNPNWDH-UHFFFAOYSA-N
ID: 114027
SMILES:c1(O)c(CC=C(C)CCC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 114028
SMILES:OC12CC(C)(C)Oc3cc(CCC)c(Br)c(O)c3C1C=C(C)CCC=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 463.456
CB1 binding score: -16.349
InChIKey:ZEPOFCVHEBQGNZ-UHFFFAOYSA-N
ID: 114029
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)(OO)C=CC12O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -15.288
InChIKey:DRPBIGBCYBHNGN-UHFFFAOYSA-N
ID: 114030
SMILES:C12CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N