ID: 48238
SMILES:C(CCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.803
InChIKey:LANFBEBWSHYDBQ-UHFFFAOYSA-N
ID: 48239
SMILES:CC1(C)C(=O)C2=C(C(C)(CO)Oc3c2c(O)cc(CCC)c3)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.402
InChIKey:ONRZIDPCIUCSMH-UHFFFAOYSA-N
ID: 48240
SMILES:C(c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.988
InChIKey:SOJHVNJFTZELFD-UHFFFAOYSA-N
ID: 48241
SMILES:C(CCCCCCCC=CCCCCCCCC)CCC(OCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 580.894
CB1 binding score: -12.179
InChIKey:QPJZCGGDUKXVPM-UHFFFAOYSA-N
ID: 48242
SMILES:C1(c2c(O)cc(CCCCC)cc2)C(C)(C)OC(C2(C)C(C=O)=CC(O)CC2C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.089
InChIKey:CHHKYWNKJPAMSC-UHFFFAOYSA-N
ID: 48243
SMILES:C1C(C)(C)C2C(C)(CC1)Oc1c(c(O)cc(CCCCCO)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 332.484
CB1 binding score: -16.444
InChIKey:OCQYEANSATYCLJ-UHFFFAOYSA-N
ID: 48244
SMILES:C1(c2c(O)cc(CCC)cc2O)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 48245
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)CC21)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.666
InChIKey:VQHSSDYOIFHIPB-UHFFFAOYSA-N
ID: 48246
SMILES:c1(CCc2cc(O)cc(OC)c2)cc(O)c2c(c1)C1=C(C(C)(C)O2)CCC(C)C1
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -15.015
InChIKey:SABRMGJYVHUOJF-UHFFFAOYSA-N
ID: 48247
SMILES:CC(CC1(C)C2CCC=C(C)Cc3c1c(O)ccc3OC2(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -11.984
InChIKey:UJUAKDXOCXOMHO-UHFFFAOYSA-N
ID: 48248
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.297
InChIKey:GWBHTJAMHUQRJX-UHFFFAOYSA-N
ID: 48249
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 48250
SMILES:CCCCCc1cc2c(c(O)c1)C13C4C(C(O)CC1)CC(C(=C)C)(C=C3CNC)C4NCC#C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.662
CB1 binding score: -13.991
InChIKey:HGLCBOVAPZKRDK-UHFFFAOYSA-N
ID: 48251
SMILES:c1(C)cc(O)c2c3c1OC(C)(C)C1CCC(C)C2CC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.321
InChIKey:CXISBFUTZQHUDJ-UHFFFAOYSA-N
ID: 48252
SMILES:C1(=O)CC2C(C=C1C)c1c(c(C(=O)O)c(CCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -13.499
InChIKey:CWOHEJUBFXCGCB-UHFFFAOYSA-N
ID: 48253
SMILES:O1C2c3c(cc(CCCCC)cc3OC3(C)CCCC4(C)CCC(C(O)(C)CCC(C(=C)C)O)OC43)OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.73
CB1 binding score: -14.241
InChIKey:PLMYTEXPFLGSQV-UHFFFAOYSA-N
ID: 48254
SMILES:C1c2c(C(=O)OCC3(C)CCC(C=O)C4C3C(C)=CC4(O)CO)c(O)cc(CCCCC)c2OC(C)(C)C1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 598.821
CB1 binding score: -12.521
InChIKey:NWKDWLVDQWSQNB-UHFFFAOYSA-N
ID: 48255
SMILES:c12cc(O)c(Br)cc1OC(CCC(OC(=O)C(C)CC)c1cc(CCCCC)cc(O)c1)(C)C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 561.557
CB1 binding score: -16.232
InChIKey:WGTWCIVHCUZRAV-UHFFFAOYSA-N
ID: 48256
SMILES:C1C=C(C)CC2c3c(O)cc(CCCCC)c(C(=O)O)c3OC(C)(C)C2CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.135
InChIKey:NXLLEONIHDJVED-UHFFFAOYSA-N
ID: 48257
SMILES:C12(C)Oc3c(c(OC)cc(CCCCC)c3)C3C=C1C(CCC2C=O)C(C(C)(O)C)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -14.69
InChIKey:KLHMJRNMCYPBBV-UHFFFAOYSA-N
ID: 48258
SMILES:Oc1cc(CCCCC)cc2c1C1C3C(C(C(C)(C)O)CCC1(C)O2)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.221
InChIKey:MQKAEMWHVOMGGL-UHFFFAOYSA-N