ID: 82237
SMILES:CC1=C(C=C)NN=C1c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.613
CB1 binding score: Not available
InChIKey:XWRHXNMDJQZPNO-UHFFFAOYSA-N
ID: 82238
SMILES:C1C=C(C)CCC(C(=C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.358
InChIKey:VXJTXJOKIPKJFI-UHFFFAOYSA-N
ID: 82239
SMILES:C(C=C(CCC=C(C)C)C)CC(=CCc1c(O)c(C(=O)O)c(CCCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 442.64
CB1 binding score: -16.826
InChIKey:KYJBDDQXNOIBPK-UHFFFAOYSA-N
ID: 82240
SMILES:C1(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2(CCC(OC(C)=O)C(=C)C)C1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -13.811
InChIKey:WUVOIMDPYUADID-UHFFFAOYSA-N
ID: 82241
SMILES:c1(CCCC)cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.779
InChIKey:VXMYRUJLTHSFQU-UHFFFAOYSA-N
ID: 82242
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.774
InChIKey:GKYGKYSJIDSYCQ-UHFFFAOYSA-N
ID: 82243
SMILES:C(CCC(C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 82244
SMILES:Oc1c2c(c(OC)c(CCC(C(CC=C(C)C)O)(O)C)c1O)OC(C)(C)C1C2C=C(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.594
CB1 binding score: -13.437
InChIKey:ACSNGJZQWYQOOH-UHFFFAOYSA-N
ID: 82245
SMILES:C12C(C(C)(C)Oc3cc(CCc4cccc(O)c4)cc(O)c31)CCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.458
CB1 binding score: -15.597
InChIKey:LZSDUVYYFNLRDQ-UHFFFAOYSA-N
ID: 82246
SMILES:CC1C2C(C(C(C)C)CC1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.059
InChIKey:DFDPTHLLXVCMEU-UHFFFAOYSA-N
ID: 82247
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 82248
SMILES:OC1(C)Oc2cc(CCCC)cc(O)c2C2C1CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.67
InChIKey:DCUPNIWMDRYAQK-UHFFFAOYSA-N
ID: 82249
SMILES:C1C2C(C)(CCC2CC(C)(C)O)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -13.249
InChIKey:VNHIPMDAJQPOFA-UHFFFAOYSA-N
ID: 82250
SMILES:C1(C)C(CCC(=CCc2c(O)c(C)cc(OC)c2)C)(C)OC(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.375
InChIKey:DKQWGKOAUFOPNL-UHFFFAOYSA-N
ID: 82251
SMILES:C(C)CCCc1cc(O)cc2c1C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.531
InChIKey:MSIRGPCXDIHSAM-UHFFFAOYSA-N
ID: 82252
SMILES:c1c(CCCC)c(C(=O)O)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.936
InChIKey:TZFPIQSSTVIJTQ-UHFFFAOYSA-N
ID: 82253
SMILES:Oc1cc2c(cc1CCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.855
InChIKey:FQQYHGYHDMLOAM-UHFFFAOYSA-N
ID: 82254
SMILES:c12c(cc(CCCCC)cc1O)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: 82255
SMILES:CCCCCC(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.752
InChIKey:PQLUJRLRLLCJPO-UHFFFAOYSA-N
ID: 82256
SMILES:c1(CCC)c2c(cc(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.579
InChIKey:FNSJYNGRQSLXJG-UHFFFAOYSA-N
ID: 82257
SMILES:C1(C)=CCCC(C)=CC2OC(C)(C)C(Br)CC2(O)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 477.483
CB1 binding score: -15.472
InChIKey:GPIGFNLYADSACN-UHFFFAOYSA-N