ID: 114598
SMILES:c1(O)c2c(c(O)cc1CCCCC)C1C=C(CCCC(C)=C)C(=O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.12
InChIKey:OEQVIABCGRJKIE-UHFFFAOYSA-N
ID: 114599
SMILES:C1=C(C)CC2(O)C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.751
InChIKey:UOSWLQIIJRKKSU-UHFFFAOYSA-N
ID: 114600
SMILES:Cc1c(CCC(C)C(C)=C)c2c(c(O)c1)CCC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.346
InChIKey:DZOGXMJPMXHFEP-UHFFFAOYSA-N
ID: 114601
SMILES:C(CC(C)C)CC1(C)Oc2c(C(C(C)CC)=O)c(O)cc(C)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.358
InChIKey:IUKZQQKLBWQNGA-UHFFFAOYSA-N
ID: 114602
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 114603
SMILES:c1(CC(C)C)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.315
InChIKey:WTRKRGRMUBVMKA-UHFFFAOYSA-N
ID: 114604
SMILES:C1(C(C(=O)O)=C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.943
InChIKey:ZTBXIRMUKGVCPS-UHFFFAOYSA-N
ID: 114605
SMILES:C1C(C)=CC(c2c(O)cc(C=CC(C)(CCC=C(C)C)O)cc2O)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.438
InChIKey:YTMHKIFFEZKWDV-UHFFFAOYSA-N
ID: 114606
SMILES:c1c(C)cc2c(c1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 114607
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 114608
SMILES:c1(CCCCC)ccc2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.423
InChIKey:MRLLOLSGDYQJHB-UHFFFAOYSA-N
ID: 114609
SMILES:C1(C)(C)C2C1(c1c(O)cc(CCCCC)cc1O)C(O)C(O)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.785
InChIKey:KMWJJTKYQDNLFJ-UHFFFAOYSA-N
ID: 114610
SMILES:c1(CCCCC)cc(O)c2c(c1)OC1(C)C(O)(C2C=C(C)C)C(=O)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.929
InChIKey:LYPAWTSURBOBLZ-UHFFFAOYSA-N
ID: 114611
SMILES:C1(C)=CCC(C)(C)C=CCC2(C)Oc3c(c(O)cc(CCC)c3)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -12.831
InChIKey:LUMPRYPVBACCBZ-UHFFFAOYSA-N
ID: 114612
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.855
InChIKey:KBTNQOVTNZTJGJ-UHFFFAOYSA-N
ID: 114613
SMILES:C12C(C)(C)Oc3cc(CCCC(C)=O)ccc3C1C(C(C)=C)C1C(O)C(C)CC1(C)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.409
InChIKey:BBQUUZPWNKCKPJ-UHFFFAOYSA-N
ID: 114614
SMILES:S1(CC)CC2C(=O)CC3C(C)(C)Oc4ccc(C(OC)=O)cc4C(C=C2C)C13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.556
CB1 binding score: -14.758
InChIKey:NCNCEJXVLSULIG-UHFFFAOYSA-N
ID: 114615
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C1c1cc(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -12.626
InChIKey:YFBDGHFMWOAZHE-UHFFFAOYSA-N
ID: 114616
SMILES:C(=C1C(OC(=O)C)c2c(O)cc(CCCCC)cc2OC1(C)C)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -14.18
InChIKey:ANFPIYMUVGWZAA-UHFFFAOYSA-N
ID: 114617
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(OC)=O)C(OC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.747
InChIKey:HENJVEXWSCKZTG-UHFFFAOYSA-N
ID: 114618
SMILES:CC(c1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)C1=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -13.658
InChIKey:RHZYBFGSKPQZMW-UHFFFAOYSA-N