ID: 89083
SMILES:C1C2C(C)(C)Oc3c(cc(O)cc3)C2C=C(CCC=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.928
InChIKey:DGUQUBKHLMEUOJ-UHFFFAOYSA-N
ID: 89084
SMILES:CC(=CCCC(=CCCC1(C)C=Cc2c(cc(CCCCC)cc2O)O1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 89085
SMILES:c1c(CCCCCC)ccc(C2C=C(C)CCC2C(C)(C)O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -16.579
InChIKey:JNOPEZOPWPXYAL-UHFFFAOYSA-N
ID: 89086
SMILES:Oc1c(CC=C(C)C)cc2c(c1C(C)=O)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.041
InChIKey:HOLWSOSDKVZENP-UHFFFAOYSA-N
ID: 89087
SMILES:c1(CC(O)=O)c(C)c2c(c3c1-c1c(cc(C)c(C(C)(C)C)c1)OC(C)(C)C1CCC(C)=CC31)CC1(C)CCC(C(O)(C)C)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 614.867
CB1 binding score: -16.425
InChIKey:UFJSBALTORAPGE-UHFFFAOYSA-N
ID: 89088
SMILES:C1C23CCC4(O)C(C(=C(C)C1)OC2C(O)C(CO)CO3)c1c(O)cc(CCCCC)cc1O4
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.567
CB1 binding score: -14.805
InChIKey:JWAYPWJGTVMSIY-UHFFFAOYSA-N
ID: 89089
SMILES:C(CCC)Cc1ccc2c(c1C)OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.015
InChIKey:MSXGEJFNHZJFQF-UHFFFAOYSA-N
ID: 89090
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.037
InChIKey:WUDZOFOMCJWPRV-UHFFFAOYSA-N
ID: 89091
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 89092
SMILES:c1c(O)c2c(cc1O)C1CC(CO)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -17.097
InChIKey:WXOIPNKWJFESJL-UHFFFAOYSA-N
ID: 89093
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 89094
SMILES:C1CC2CC(C(=C)C1Oc1cc(CCCCCC)cc(OC)c1O)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.929
InChIKey:WAVUCIXDKMSCNB-UHFFFAOYSA-N
ID: 89095
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1c2c(OC)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.213
InChIKey:UHLNEMXDLSJNQX-UHFFFAOYSA-N
ID: 89096
SMILES:c12c(C(=O)O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.51
InChIKey:ONTMVGJDPXZQKB-UHFFFAOYSA-N
ID: 89097
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3c(c(O)c(C=O)c(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.087
InChIKey:BEVOCLBXFFTZDN-UHFFFAOYSA-N
ID: 89098
SMILES:C1(=C)CCC2C3(COC2=O)C1c1c(cc(CCCCC)cc1O)OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.009
InChIKey:ZBUFOROHFHBEGR-UHFFFAOYSA-N
ID: 89099
SMILES:C1(CCC(=O)OC)=CCCC(C)C1(Cc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.106
InChIKey:SBKOYOCUQJBZCQ-UHFFFAOYSA-N
ID: 89100
SMILES:c1(O)c(CC=C(C)CCC=C(C)[CH])c(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.929
InChIKey:LCMPEPSZXSLQQK-UHFFFAOYSA-N
ID: 89101
SMILES:C1=C(C)C2Oc3cc(CCCCC)cc(O)c3C2C2C1(C)CCC2(O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.866
InChIKey:ALOBSKMKQNJSTM-UHFFFAOYSA-N
ID: 89102
SMILES:CC1=CC(c2ccc(CCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.46
CB1 binding score: -18.171
InChIKey:QBUIJIADVGCWQN-UHFFFAOYSA-N
ID: 89103
SMILES:CC1C2(C3(C)CCCC(CO)(C)C3C(=O)C1)Oc1c(c(O)cc(CCCC)c1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.452
InChIKey:WCWKKKUAMARNIR-UHFFFAOYSA-N