ID: 95908
SMILES:C12C(C(O)C(CO)(O)CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.008
InChIKey:MVVVSODGTGFZOV-UHFFFAOYSA-N
ID: 95909
SMILES:C1(=O)C2(Oc3c(c(O)cc(CCCCC)c3)C2)OC(CCC(C(C)=C)=O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.793
InChIKey:MWOJRGJSXRIGSI-UHFFFAOYSA-N
ID: 95910
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 95911
SMILES:O(c1ccc2c(c1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.071
InChIKey:QJRPBWFSXAYWJJ-UHFFFAOYSA-N
ID: 95912
SMILES:c1(CCCCl)c2c(c(O)c(CC=C(C)C)c1O)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.993
CB1 binding score: -16.879
InChIKey:KQVKWAHYLKBCSQ-UHFFFAOYSA-N
ID: 95913
SMILES:Oc1c(CC=C(C)C)cc(O)cc1CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 248.366
CB1 binding score: -17.913
InChIKey:OZBDRWFBMCCJHI-UHFFFAOYSA-N
ID: 95914
SMILES:C1(OC(C(=C)C)=O)C(Oc2c(CCCCCC)cc3c(c2O)C2C(CCC(C)=C2)C(C)(C)O3)OC(c2ccc(O)cc2)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 632.838
CB1 binding score: -15.597
InChIKey:IUSPXWSHBUDGQD-UHFFFAOYSA-N
ID: 95915
SMILES:C(CC(C)C)(c1cc2c(c(O)c1CCCCC)OC(C)(C)C1CCC(C)(O)C=C12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.21
InChIKey:FYEUPPJUVVESKY-UHFFFAOYSA-N
ID: 95916
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 95917
SMILES:Oc1cc(CCCCC)cc2c1C1=C(C(C)(C)O2)CC(C)(O)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.088
InChIKey:XHJMFTVJKPSKKU-UHFFFAOYSA-N
ID: 95918
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 95919
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 95920
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C=CC(C)(O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.25
InChIKey:PGZISGZFEFJPOZ-UHFFFAOYSA-N
ID: 95921
SMILES:C(CC)CCc1c(O)c2c(c(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -11.592
InChIKey:LBLMAOSWUWVEGC-UHFFFAOYSA-N
ID: 95922
SMILES:C1(C)(C)Oc2cc(O)c(C(O)=O)c(C)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.608
InChIKey:YEDKLDOXYDQPER-UHFFFAOYSA-N
ID: 95923
SMILES:O=C(C(C1Cc2c(CCCCC)cc(O)cc2OC1(C)CCC=C(C)C)=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.23
InChIKey:VJTOFIRLXBHVCK-UHFFFAOYSA-N
ID: 95924
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccc(O)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 95925
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)=CC(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N
ID: 95926
SMILES:O=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.069
InChIKey:CADNUHLERCFBSB-UHFFFAOYSA-N
ID: 95927
SMILES:CC1(C)C2CCC(C)=CC2c2c(c3c(cco3)c(C=O)c2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.365
CB1 binding score: -15.569
InChIKey:NXDRBBRQKLDQIH-UHFFFAOYSA-N
ID: 95928
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -17.749
InChIKey:RYPNSSJHEQPCOF-UHFFFAOYSA-N