ID: 47587
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCC)c2)C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 47588
SMILES:c1(CCCCC)cc2c(c(O)c1C=O)OC(C(C)(CCC=C(C)C)O)o2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.794
InChIKey:QXEFKJOPKAZAJK-UHFFFAOYSA-N
ID: 47589
SMILES:C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 47590
SMILES:C1C2(C)C3C(C(CO)(C)OC13)c1c(cc(C)cc1O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -17.009
InChIKey:LAYYWSLZJHWYEQ-UHFFFAOYSA-N
ID: 47591
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C1C=C(C)C(=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.058
InChIKey:UXOBYFHCQYPOAT-UHFFFAOYSA-N
ID: 47592
SMILES:C(C)(C(=O)OCc1cc(OC)c(CC=C(CCC=C(C)C)C)c(O)c1)C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -17.402
InChIKey:MYVBOPLOQKATBX-UHFFFAOYSA-N
ID: 47593
SMILES:C(=CC)CCc1c(C(O)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.871
InChIKey:XXYDASRTYCHVRT-UHFFFAOYSA-N
ID: 47594
SMILES:C(CCC)Cc1cc(O)c(CC2C(O)(C)CCC3C(C)(C)CCCC23C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -16.777
InChIKey:NSLRLRLKYZPEPW-UHFFFAOYSA-N
ID: 47595
SMILES:C(C(C)=CCc1c(O)cc(CCCCC)cc1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 47596
SMILES:CC1(C)C2(O)C(O)CC(C)=CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -10.666
InChIKey:UKYJXSVEOPCWCN-UHFFFAOYSA-N
ID: 47597
SMILES:C(C)(=C1C(O)C(c2c(O)cc(CCCCC)cc2O)C(CO)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.898
InChIKey:XKGUOJIAWVJIPM-UHFFFAOYSA-N
ID: 47598
SMILES:C(C(CC(C)C)OC(=O)C)C1(C)Oc2cc(CCCC)cc(O)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.952
InChIKey:QZFJRPOCWXYHRG-UHFFFAOYSA-N
ID: 47599
SMILES:c1(O)c2c(cc(C(C)(C=C)C)c1)OC(C)(C)C1CC=C(CCC=C(C)C)C=C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -16.41
InChIKey:ABNXYRLHOPYQGU-UHFFFAOYSA-N
ID: 47600
SMILES:C(C)(C)C1CCC2(C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.251
InChIKey:GIVNWDNDDALTHM-UHFFFAOYSA-N
ID: 47601
SMILES:Oc1cc2c(c(C(=O)CC(C)C)c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.448
InChIKey:HGBJAQKTOUEFRO-UHFFFAOYSA-N
ID: 47602
SMILES:C(CCCCO)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.833
InChIKey:KSMJKBAPIPQWOY-UHFFFAOYSA-N
ID: 47603
SMILES:C1(C)(C)Oc2cc(CCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 47604
SMILES:C(c1c(O)c(O)c2c(c1)OC(C)(C)C1C2C(O)C=C1C)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.428
InChIKey:RDUYNSZNARTJPG-UHFFFAOYSA-N
ID: 47605
SMILES:c1(O)c2c(c(O)cc1CCCCC)OC(C)(C)C1[CH]CC(C)(O)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.459
CB1 binding score: -12.947
InChIKey:CBXGTRNTBLCQGG-UHFFFAOYSA-N
ID: 47606
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.052
InChIKey:LBQIJXCKRZTRPV-UHFFFAOYSA-N
ID: 47607
SMILES:CC1(C)Oc2cc(CCCC[N+](C)(C)C)cc(O)c2C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.546
CB1 binding score: -15.983
InChIKey:YMTMSEUUDWELPK-UHFFFAOYSA-O